(4Z,18Z,29E)-31-oxidanyltritriaconta-4,18,29-trien-2,32-diynoic acid

Systemtic Name: (4Z,18Z,29E)-31-oxidanyltritriaconta-4,18,29-trien-2,32-diynoic acid Openeye Name: (4Z,18Z,29E)-31-hydroxytritriaconta-4,18,29-trien-2,32-diynoic acid CAS Name: (4Z,18Z,29E)-31-hydroxytritriaconta-4,18,29-trien-2,32-diynoic acid IUPAC Name: (4Z,18Z,29E)-31-hydroxytritriaconta-4,18,29-trien-2,32-diynoic acid Traditional Name: (4Z,18Z,29E)-31-hydroxytritriaconta-4,18,29-trien-2,32-diynoic acid Formula: C33H52O3 MolecularWeight: 496.76418

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(C=CCCCCCCCCCC=CCCCCCCCCCCCCC=CC#CC(=O)O)O

Isomeric SMILES

C#CC(/C=C/CCCCCCCCC/C=C\CCCCCCCCCCCC/C=C\C#CC(=O)O)O

InChI

InChI=1S/C33H52O3/c1-2-32(34)30-28-26-24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33(35)36/h1,6,8,25,27-28,30,32,34H,3-5,7,9-24,26H2,(H,35,36)/b8-6-,27-25-,30-28+